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Compound: 5546
Plants: 312
References: 992
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momilactone A
ScientificNameLabel
momilactone A
PHCD compound ID :
1380
Chemical Names :
momilactone A
Molecular Formula :
C20H26O3
Molecular Weight :
314.188195
More Details :
Names & Synonyms:
Smiles:
C=C[C@]1(C)CC[C@@H]2C(=C[C@@H]3[C@@H]4[C@]2(C)CCC(=O)[C@@]4(C(=O)O3)C)C1
InChi :
InChI=1S/C20H26O3/c1-5-18(2)8-6-13-12(11-18)10-14-16-19(13,3)9-7-15(21)20(16,4)17(22)23-14/h5,10,13-14,16H,1,6-9,11H2,2-4H3/t13-,14-,16-,18-,19-,20+/m1/s1
InChi Key :
InChIKey=MPHXYQVSOFGNEN-JGHPTVLTSA-N
PubChem ID :
162644
Rotatable bond count :
1
Rule of five :
0
Hydrogen bond acceptor count :
3
Ionization potential :
9.844886
Hydrogen bond donor count :
0
Electric dipole moment :
7.336
XLogP :
4.286
VDW volume :
320.875162
Molecular weight :
314.188195
HOMO-LUMO gap :
10.302000
Herb list :
Rice - Oryza sativa - برنج
Refrences & Litretures:
146. Journal:'Phytochem. Anal' Year:'2006' Volume:'17' Page:'36' DOI:'10.1002/pca.879' Title:'Chemical Constituents of Rice (Oryza sativa) Hulls and their Herbicidal Activity against Duckweed (Lemna paucicostata Hegelm 381)'
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